Difference between revisions of "Software:cpmd"

Revision as of 17:24, 27 May 2016 (view source) Hasch (Talk | contribs) (Created page with "== Car-Parinello Molecular Dynamics (CPMD) == {| style="border-spacing: 8px;" The CPMD code is a parallelized plane wave/pseudopotential implementation of Density Functional...")		Revision as of 16:40, 30 May 2016 (view source) Hasch (Talk | contribs) (→‎Car-Parinello Molecular Dynamics (CPMD)) Newer edit →
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	* '''Related link''': For more information go to [http://www.cpmd.org/ the CPMD consortium page]		* '''Related link''': For more information go to [http://www.cpmd.org/ the CPMD consortium page]
	* '''Statement''': [http://www.hpcvl.org/sites/default/files/hpvcl_cpmd_statement.pdf Required to access the software]		* '''Statement''': [http://www.hpcvl.org/sites/default/files/hpvcl_cpmd_statement.pdf Required to access the software]
−	* '''Help File''': [[HowTo:cpmd|Car-Parinello Molecular Dynamnics Help file]]	+	* '''Help File''': [[HowTo:cpmd|Car-Parinello Molecular Dynamics Help file]]
	|}		|}
	* '''Related Software''':		* '''Related Software''':

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Revision as of 16:40, 30 May 2016

Car-Parinello Molecular Dynamics (CPMD)

The CPMD code is a parallelized plane wave/pseudopotential implementation of Density Functional Theory, particularly designed for ab-initio Molecular Dynamics simulation as described by Car and Parinello. CPMD runs on many different computer architectures and it is well parallelized.

• Current Version: 3.13
• Location: /opt/cpmd
• Related link: For more information go to the CPMD consortium page
• Statement: Required to access the software
• Help File: Car-Parinello Molecular Dynamics Help file

• Related Software:

ADF

Amber

Gamess

NAMD

NWChem